4-[(1-acetyl-2-methyl-6-morpholin-4-yl-3,4-dihydro-2H-quinolin-4-yl)amino]-3-methylbenzamide

C24H30N4O3 — CID 46932548

IUPAC4-[(1-acetyl-2-methyl-6-morpholin-4-yl-3,4-dihydro-2H-quinolin-4-yl)amino]-3-methylbenzamide
SMILESCC(=O)N1c2ccc(N3CCOCC3)cc2C(Nc2ccc(C(N)=O)cc2C)CC1C
InChIInChI=1S/C24H30N4O3/c1-15-12-18(24(25)30)4-6-21(15)26-22-13-16(2)28(17(3)29)23-7-5-19(14-20(22)23)27-8-10-31-11-9-27/h4-7,12,14,16,22,26H,8-11,13H2,1-3H3,(H2,25,30)
InChIKeyXKYVHUXSLOBPTD-UHFFFAOYSA-N
MW422.53 g/mol
LogP3.23
Rot. Bonds4

About 4-[(1-acetyl-2-methyl-6-morpholin-4-yl-3,4-dihydro-2H-quinolin-4-yl)amino]-3-methylbenzamide

4-[(1-acetyl-2-methyl-6-morpholin-4-yl-3,4-dihydro-2H-quinolin-4-yl)amino]-3-methylbenzamide (PubChem CID 46932548) has the molecular formula C24H30N4O3 and a molecular weight of 422.53 g/mol. Its IUPAC name is 4-[(1-acetyl-2-methyl-6-morpholin-4-yl-3,4-dihydro-2H-quinolin-4-yl)amino]-3-methylbenzamide.

Molecular Properties

Compound Name4-[(1-acetyl-2-methyl-6-morpholin-4-yl-3,4-dihydro-2H-quinolin-4-yl)amino]-3-methylbenzamide
PubChem CID46932548
Molecular FormulaC24H30N4O3
Molecular Weight422.53 g/mol
Exact Mass422.23
IUPAC Name4-[(1-acetyl-2-methyl-6-morpholin-4-yl-3,4-dihydro-2H-quinolin-4-yl)amino]-3-methylbenzamide
SMILESCC(=O)N1c2ccc(N3CCOCC3)cc2C(Nc2ccc(C(N)=O)cc2C)CC1C
InChIInChI=1S/C24H30N4O3/c1-15-12-18(24(25)30)4-6-21(15)26-22-13-16(2)28(17(3)29)23-7-5-19(14-20(22)23)27-8-10-31-11-9-27/h4-7,12,14,16,22,26H,8-11,13H2,1-3H3,(H2,25,30)
InChIKeyXKYVHUXSLOBPTD-UHFFFAOYSA-N
XLogP3.23
TPSA87.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.53
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-[(1-acetyl-2-methyl-6-morpholin-4-yl-3,4-dihydro-2H-quinolin-4-yl)amino]-3-methylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-acetyl-2-methyl-4-(4-morpholin-4-ylanilino)-3,4-dihydro-2H-quinoline-6-carboxamide
CID 25254949
1-acetyl-2-methyl-4-(3-morpholin-4-ylanilino)-3,4-dihydro-2H-quinoline-6-carboxamide
CID 58032147
4-[(1-acetyl-6-fluoro-2-methyl-3,4-dihydro-2H-quinolin-4-yl)amino]-3-methylbenzamide
CID 66625549
6-[[1-acetyl-2-methyl-4-(4-morpholin-4-ylanilino)-3,4-dihydro-2H-quinoline-6-carbonyl]amino]hexanoic acid
CID 90374048
ethyl 4-[[1-acetyl-6-(methanesulfonamido)-2-methyl-3,4-dihydro-2H-quinolin-4-yl]amino]-3-methylbenzoate
CID 66624855
(2S,4R)-1-acetyl-4-[4-(2-amino-2-oxoethyl)anilino]-2-methyl-3,4-dihydro-2H-quinoline-6-carboxamide
CID 66625459
2-[4-[[(2R,4S)-1-acetyl-6-carbamoyl-2-methyl-3,4-dihydro-2H-quinolin-4-yl]amino]phenyl]acetic acid
CID 66625594
4-[4-[[1-acetyl-2-methyl-4-(4-morpholin-4-ylanilino)-3,4-dihydro-2H-quinoline-6-carbonyl]amino]phenyl]-2-methylbutanoic acid
CID 66634457
1-[(2R,4S)-2-methyl-4-(3-methylanilino)-6-(4-piperidin-1-ylphenyl)-3,4-dihydro-2H-quinolin-1-yl]ethanone
CID 52933251
1-[2-methyl-4-(2-methylanilino)-3,4-dihydro-2H-quinolin-1-yl]ethanone
CID 25253600
1-[2-methyl-6-[4-(morpholine-4-carbonyl)phenyl]-4-(pyridin-2-ylamino)-3,4-dihydro-2H-quinolin-1-yl]ethanone
CID 78077976
1-[4-(4-chloroanilino)-6-[(3R,5S)-3,5-dimethylmorpholin-4-yl]-2-methyl-3,4-dihydro-2H-quinolin-1-yl]ethanone
CID 66625850

Frequently Asked Questions

What is the IUPAC name of 4-[(1-acetyl-2-methyl-6-morpholin-4-yl-3,4-dihydro-2H-quinolin-4-yl)amino]-3-methylbenzamide?
The IUPAC name of 4-[(1-acetyl-2-methyl-6-morpholin-4-yl-3,4-dihydro-2H-quinolin-4-yl)amino]-3-methylbenzamide (CID 46932548) is 4-[(1-acetyl-2-methyl-6-morpholin-4-yl-3,4-dihydro-2H-quinolin-4-yl)amino]-3-methylbenzamide.
What is the SMILES notation for 4-[(1-acetyl-2-methyl-6-morpholin-4-yl-3,4-dihydro-2H-quinolin-4-yl)amino]-3-methylbenzamide?
The canonical SMILES for 4-[(1-acetyl-2-methyl-6-morpholin-4-yl-3,4-dihydro-2H-quinolin-4-yl)amino]-3-methylbenzamide is CC(=O)N1c2ccc(N3CCOCC3)cc2C(Nc2ccc(C(N)=O)cc2C)CC1C.
What is the InChIKey of 4-[(1-acetyl-2-methyl-6-morpholin-4-yl-3,4-dihydro-2H-quinolin-4-yl)amino]-3-methylbenzamide?
The InChIKey is XKYVHUXSLOBPTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N4O3/c1-15-12-18(24(25)30)4-6-21(15)26-22-13-16(2)28(17(3)29)23-7-5-19(14-20(22)23)27-8-10-31-11-9-27/h4-7,12,14,16,22,26H,8-11,13H2,1-3H3,(H2,25,30).
What are the key properties of 4-[(1-acetyl-2-methyl-6-morpholin-4-yl-3,4-dihydro-2H-quinolin-4-yl)amino]-3-methylbenzamide?
4-[(1-acetyl-2-methyl-6-morpholin-4-yl-3,4-dihydro-2H-quinolin-4-yl)amino]-3-methylbenzamide has a molecular weight of 422.53 g/mol, XLogP of 3.23, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1-acetyl-2-methyl-6-morpholin-4-yl-3,4-dihydro-2H-quinolin-4-yl)amino]-3-methylbenzamide is sourced from PubChem (CID 46932548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).